N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine

C17H15ClN2O — CID 692374

IUPACN-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine
SMILESCOc1ccc2nc(C)cc(Nc3cccc(Cl)c3)c2c1
InChIInChI=1S/C17H15ClN2O/c1-11-8-17(20-13-5-3-4-12(18)9-13)15-10-14(21-2)6-7-16(15)19-11/h3-10H,1-2H3,(H,19,20)
InChIKeyVPCPEZOMHMGEMP-UHFFFAOYSA-N
MW298.77 g/mol
LogP4.95
Rot. Bonds3

About N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine

N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine (PubChem CID 692374) has the molecular formula C17H15ClN2O and a molecular weight of 298.77 g/mol. Its IUPAC name is N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine.

Molecular Properties

Compound NameN-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine
PubChem CID692374
Molecular FormulaC17H15ClN2O
Molecular Weight298.77 g/mol
Exact Mass298.09
IUPAC NameN-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine
SMILESCOc1ccc2nc(C)cc(Nc3cccc(Cl)c3)c2c1
InChIInChI=1S/C17H15ClN2O/c1-11-8-17(20-13-5-3-4-12(18)9-13)15-10-14(21-2)6-7-16(15)19-11/h3-10H,1-2H3,(H,19,20)
InChIKeyVPCPEZOMHMGEMP-UHFFFAOYSA-N
XLogP4.95
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.77
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-4-fluorophenyl)-6-methoxy-2-methylquinolin-4-amine
CID 110435673
N-(3-chloro-4-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine
CID 798244
N-(5-chloro-2-methoxyphenyl)-6-methoxy-2-methylquinolin-4-amine
CID 886675
N-[(3-chlorophenyl)methylideneamino]-6-methoxy-2-methylquinolin-4-amine
CID 44537106
N-[(E)-(3-chlorophenyl)methylideneamino]-6-methoxy-2-methylquinolin-4-amine
CID 45480852
N-(4-fluorophenyl)-6-methoxy-2-methylquinolin-4-amine
CID 798853
7-methoxy-2-methyl-N-(3-methylphenyl)quinolin-4-amine
CID 110435602
6-methoxy-2-methyl-N-(4-propan-2-yloxyphenyl)quinolin-4-amine
CID 110435675
methyl 4-(3-methoxyanilino)-2-methylquinoline-6-carboxylate
CID 730949
N-(3-chlorophenyl)-8-methoxy-2-methylquinolin-4-amine
CID 23880571
6-chloro-N-(3,4-dimethoxyphenyl)-2-methylquinolin-4-amine
CID 23793112
4-[(6-methoxy-2-methylquinolin-4-yl)amino]benzoate
CID 3687425

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine?
The IUPAC name of N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine (CID 692374) is N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine.
What is the SMILES notation for N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine?
The canonical SMILES for N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine is COc1ccc2nc(C)cc(Nc3cccc(Cl)c3)c2c1.
What is the InChIKey of N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine?
The InChIKey is VPCPEZOMHMGEMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClN2O/c1-11-8-17(20-13-5-3-4-12(18)9-13)15-10-14(21-2)6-7-16(15)19-11/h3-10H,1-2H3,(H,19,20).
What are the key properties of N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine?
N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine has a molecular weight of 298.77 g/mol, XLogP of 4.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-6-methoxy-2-methylquinolin-4-amine is sourced from PubChem (CID 692374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).